N-[4-[4-(aziridin-1-ylcarbonylamino)-3,5-ditert-butyl-phenyl]sulfonyl-2,6-ditert-butyl-phenyl]aziridine-1-carboxamide

Systemtic Name: N-[4-[4-(aziridin-1-ylcarbonylamino)-3,5-ditert-butyl-phenyl]sulfonyl-2,6-ditert-butyl-phenyl]aziridine-1-carboxamide Openeye Name: N-[4-[4-(aziridine-1-carbonylamino)-3,5-ditert-butyl-phenyl]sulfonyl-2,6-ditert-butyl-phenyl]aziridine-1-carboxamide CAS Name: N-[4-[4-[[1-aziridinyl(oxo)methyl]amino]-3,5-ditert-butylphenyl]sulfonyl-2,6-ditert-butylphenyl]-1-aziridinecarboxamide IUPAC Name: N-[4-[4-(aziridine-1-carbonylamino)-3,5-ditert-butylphenyl]sulfonyl-2,6-ditert-butylphenyl]aziridine-1-carboxamide Traditional Name: N-[2,6-ditert-butyl-4-[3,5-ditert-butyl-4-(ethylenimine-1-carbonylamino)phenyl]sulfonyl-phenyl]ethylenimine-1-carboxamide Formula: C34H50N4O4S MolecularWeight: 610.8502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1NC(=O)N2CC2)C(C)(C)C)S(=O)(=O)C3=CC(=C(C(=C3)C(C)(C)C)NC(=O)N4CC4)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1NC(=O)N2CC2)C(C)(C)C)S(=O)(=O)C3=CC(=C(C(=C3)C(C)(C)C)NC(=O)N4CC4)C(C)(C)C

InChI

InChI=1S/C34H50N4O4S/c1-31(2,3)23-17-21(18-24(32(4,5)6)27(23)35-29(39)37-13-14-37)43(41,42)22-19-25(33(7,8)9)28(26(20-22)34(10,11)12)36-30(40)38-15-16-38/h17-20H,13-16H2,1-12H3,(H,35,39)(H,36,40)